Geometry & MOs
Info
ID: |
53724 |
PubChem CID: |
14717810 |
Reduced: |
O3N4C10H16 (1) |
Stoich.: |
A3B4C10D16 (1) |
Weight, g/mol: |
1124.486185 |
ΔHf, kcal/mol: |
-106.73 |
Dipole, Da: |
4.39 |
IP(EA), eV: |
-9.28(-0.03) |
Spin(Sz, S2): |
None, None |
Charge, e: |
0 |
Chem-info
IUPAC name:
4-[[2-[[2-amino-3-(4-hydroxyphenyl)propanoyl]amino]-4-methylsulfanylbutanoyl]amino]-5-[[1-[[1-[[1-[[1-(carboxymethylamino)-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-5-oxopentanoic acid